3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one

C18H14F2N4O2 — CID 127047646

IUPAC3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one
SMILESO=c1[nH]ccn1CCOc1nn(-c2ccccc2F)c2ccc(F)cc12
InChIInChI=1S/C18H14F2N4O2/c19-12-5-6-15-13(11-12)17(26-10-9-23-8-7-21-18(23)25)22-24(15)16-4-2-1-3-14(16)20/h1-8,11H,9-10H2,(H,21,25)
InChIKeySNNPFJPSCXRCFL-UHFFFAOYSA-N
MW356.33 g/mol
LogP2.87
Rot. Bonds5

About 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one

3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one (PubChem CID 127047646) has the molecular formula C18H14F2N4O2 and a molecular weight of 356.33 g/mol. Its IUPAC name is 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one.

Molecular Properties

Compound Name3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one
PubChem CID127047646
Molecular FormulaC18H14F2N4O2
Molecular Weight356.33 g/mol
Exact Mass356.11
IUPAC Name3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one
SMILESO=c1[nH]ccn1CCOc1nn(-c2ccccc2F)c2ccc(F)cc12
InChIInChI=1S/C18H14F2N4O2/c19-12-5-6-15-13(11-12)17(26-10-9-23-8-7-21-18(23)25)22-24(15)16-4-2-1-3-14(16)20/h1-8,11H,9-10H2,(H,21,25)
InChIKeySNNPFJPSCXRCFL-UHFFFAOYSA-N
XLogP2.87
TPSA64.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.33
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-3-(1-phenylindazol-3-yl)oxypropan-1-amine
CID 200264
1-(2,6-Difluorophenyl)-3-piperidin-4-yloxyindazole
CID 11674313
1-[2-[5-Fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-3-methylimidazolidin-2-one
CID 127046800
tert-butyl N-[2-[1-(2-fluorophenyl)indazol-4-yl]oxyethyl]carbamate
CID 127046804
2-[5-Fluoro-1-(2-fluorophenyl)indazol-3-yl]oxy-1-morpholin-4-ylethanone
CID 127047643
2-[5-Fluoro-1-(2-fluorophenyl)indazol-3-yl]oxy-1-morpholin-4-ylpropan-1-one
CID 127047644
N-Methyl-3-((1-(phenylmethyl)-1H-indazol-3-yl)oxy)-1-propanamine
CID 57369683
3-[2-[5-Fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1,3-oxazolidin-2-one
CID 127046801
1-[2-[1-(2,4-Difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one
CID 127046802
1-[2-[5-Fluoro-1-(4-fluorophenyl)indazol-3-yl]oxyethyl]imidazolidin-2-one
CID 127046803
1-[2-[5-Fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]imidazolidin-2-one
CID 127047645
2-(1-benzylindazol-3-yl)oxy-N,N-dimethylethanamine
CID 3028873

Frequently Asked Questions

What is the IUPAC name of 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one?
The IUPAC name of 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one (CID 127047646) is 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one.
What is the SMILES notation for 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one?
The canonical SMILES for 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one is O=c1[nH]ccn1CCOc1nn(-c2ccccc2F)c2ccc(F)cc12.
What is the InChIKey of 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one?
The InChIKey is SNNPFJPSCXRCFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N4O2/c19-12-5-6-15-13(11-12)17(26-10-9-23-8-7-21-18(23)25)22-24(15)16-4-2-1-3-14(16)20/h1-8,11H,9-10H2,(H,21,25).
What are the key properties of 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one?
3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one has a molecular weight of 356.33 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[5-fluoro-1-(2-fluorophenyl)indazol-3-yl]oxyethyl]-1H-imidazol-2-one is sourced from PubChem (CID 127047646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).